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CHEBI:171685 - Mosinone A

ChEBI IDCHEBI:171685
ChEBI NameMosinone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H64O7
Net Charge0
Average Mass620.912
Monoisotopic Mass620.46520
SMILESCCCCCCCCCC/C=C\CCC(O)C1CCC(C(O)CCCCCC(=O)CCCCC2CC(CC(C)=O)C(=O)O2)O1
InChIInChI=1S/C37H64O7/c1-3-4-5-6-7-8-9-10-11-12-13-16-23-33(40)35-25-26-36(44-35)34(41)24-17-14-15-20-31(39)21-18-19-22-32-28-30(27-29(2)38)37(42)43-32/h12-13,30,32-36,40-41H,3-11,14-28H2,1-2H3/b13-12-
InChIKeyMEZMFFSHBLPWKU-SEYXRHQNSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
Mosinone A (CHEBI:171685) is a polyketide (CHEBI:26188)
IUPAC Name 
5-[11-hydroxy-11-[5-[(Z)-1-hydroxypentadec-4-enyl]oxolan-2-yl]-5-oxoundecyl]-3-(2-oxopropyl)oxolan-2-one
Manual XrefsDatabases
HMDB0031228HMDB
35013333ChemSpider